3-Chloro-4-isobutylphenylacetic acid

Modify Date: 2025-11-29 13:21:34

3-Chloro-4-isobutylphenylacetic acid structure	Common Name	3-Chloro-4-isobutylphenylacetic acid
	CAS Number	58880-42-5	Molecular Weight	226.69900
	Density	1.162g/cm3	Boiling Point	339.2ºC at 760 mmHg
	Molecular Formula	C₁₂H₁₅ClO₂	Melting Point	N/A
	MSDS	N/A	Flash Point	159ºC

Name	2-[3-chloro-4-(2-methylpropyl)phenyl]acetic acid
Synonym	More Synonyms

Density	1.162g/cm3
Boiling Point	339.2ºC at 760 mmHg
Molecular Formula	C₁₂H₁₅ClO₂
Molecular Weight	226.69900
Flash Point	159ºC
Exact Mass	226.07600
PSA	37.30000
LogP	3.16560
Index of Refraction	1.538
InChIKey	BEDNWFVESJXIEG-UHFFFAOYSA-N
SMILES	CC(C)Cc1ccc(CC(=O)O)cc1Cl

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AF9273000

CHEMICAL NAME :: Acetic acid, (3-chloro-4-isobutylphenyl)-

CAS REGISTRY NUMBER :: 58880-42-5

LAST UPDATED :: 198309

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H15-Cl-O2

MOLECULAR WEIGHT :: 226.72

WISWESSER LINE NOTATION :: QV1R CG D1Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TAKHAA Takeda Kenkyusho Ho. Journal of the Takeda Research Laboratories. (Takeda Yakuhin Kogyo K.K., 2-17-85 Jusohon-machi, Yodogawa-ku, Osaka 532, Japan) V.29- 1970- Volume(issue)/page/year: 34,467,1975

Benzeneacetic acid,3-chloro-4-(2-methylpropyl)

(3-Chloro-4-isobutylphenyl)acetic acid

ACETIC ACID,(3-CHLORO-4-ISOBUTYLPHENYL)

TAI 254

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China
Product Name: Palmitic acid
Price: Check
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Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 3-Chloro-4-isobutylphenylacetic acid
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
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